2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide

C17H26N2O3 — CID 108901080

IUPAC2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide
SMILESCOc1cccc(CCNC(=O)N2CCCCC2CCO)c1
InChIInChI=1S/C17H26N2O3/c1-22-16-7-4-5-14(13-16)8-10-18-17(21)19-11-3-2-6-15(19)9-12-20/h4-5,7,13,15,20H,2-3,6,8-12H2,1H3,(H,18,21)
InChIKeyZDRPCGICYLUWPR-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.18
Rot. Bonds6

About 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide

2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide (PubChem CID 108901080) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide
PubChem CID108901080
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide
SMILESCOc1cccc(CCNC(=O)N2CCCCC2CCO)c1
InChIInChI=1S/C17H26N2O3/c1-22-16-7-4-5-14(13-16)8-10-18-17(21)19-11-3-2-6-15(19)9-12-20/h4-5,7,13,15,20H,2-3,6,8-12H2,1H3,(H,18,21)
InChIKeyZDRPCGICYLUWPR-UHFFFAOYSA-N
XLogP2.18
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-[2-(3,5-dimethoxyphenyl)ethyl]-2-(hydroxymethyl)piperidine-1-carboxamide
CID 126428815
(2S)-2-(2-hydroxyethyl)-N-[2-(4-methylphenyl)ethyl]piperidine-1-carboxamide
CID 124670162
N-[2-(3-methoxyphenyl)ethyl]cyclohexanecarboxamide
CID 47041879
2-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-1-carboxamide
CID 108898255
2-(hydroxymethyl)-N-[2-(4-methoxyphenyl)ethyl]pyrrolidine-1-carboxamide
CID 111427687
1-[(3-methoxyphenyl)methylcarbamoyl]piperidine-2-carboxylic acid
CID 61208442
N-[(3-fluorophenyl)methyl]-2-(2-hydroxyethyl)piperidine-1-carboxamide
CID 108898597
1-[2-(hydroxymethyl)piperidin-1-yl]-2-(3-methoxyphenyl)ethanone
CID 43421553
1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-(3-methoxyphenyl)propan-1-one
CID 66262478
N-[(3,4-dimethylphenoxy)methyl]-2-(2-hydroxyethyl)piperidine-1-carboxamide
CID 108879278
2-(azepan-1-yl)-N-[2-(3-methoxyphenyl)ethyl]-2-oxoacetamide
CID 108985455
2-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]propanamide
CID 110355667

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide?
The IUPAC name of 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide (CID 108901080) is 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide?
The canonical SMILES for 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide is COc1cccc(CCNC(=O)N2CCCCC2CCO)c1.
What is the InChIKey of 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide?
The InChIKey is ZDRPCGICYLUWPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-22-16-7-4-5-14(13-16)8-10-18-17(21)19-11-3-2-6-15(19)9-12-20/h4-5,7,13,15,20H,2-3,6,8-12H2,1H3,(H,18,21).
What are the key properties of 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide?
2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide has a molecular weight of 306.41 g/mol, XLogP of 2.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 108901080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).